Fluoride

Fluoride

SCHEMBL28098374

C=C(C)C(=O)OCCCCCC.F

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.96
THRB P10828 1/20 0.55
NAAA Q02083 1/20 0.53
POLB P06746 1/20 0.51
APEX1 P27695 1/20 0.51
HTT P42858 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
EPHX1 P07099 1/20 0.50
RAD52 P43351 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALDH1A1 P00352 2/20 0.48
CES2 O00748 1/20 0.47
HCAR2 Q8TDS4 1/20 0.46
FAAH O00519 1/20 0.44
LMNA P02545 1/20 0.44
ACHE P22303 5/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Fluoride SCHEMBL28093519 1.00 TSHR (0.96) TSHRTHRBNAAAPOLBAPEX1
Fluoride SCHEMBL27813530 1.00 TSHR (0.96) TSHRTHRBNAAAPOLBAPEX1
Fluoride SCHEMBL27448070 1.00 TSHR (0.96) TSHRTHRBNAAAPOLBAPEX1
Fluoride SCHEMBL28133631 1.00 TSHR (0.96) TSHRTHRBNAAAPOLBAPEX1
Fluoride SCHEMBL28093437 1.00 TSHR (0.96) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL11775454 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL14995 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL1977194 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL15200 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1
SCHEMBL6655183 0.98 TSHR (1.00) TSHRTHRBNAAAPOLBAPEX1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103665280-B A kind of multi-functional fluorine-containing microballoon and preparation method and application 中科院广州化学有限公司 2016-09-07 CN claimed
CN-105683304-B Article having a coating on a substrate, coating composition and coating method 埃西勒国际通用光学公司 2018-05-22 CN disclosed
CN-105980416-B Fluorine-containing macromole evocating agent and its manufacture method 优迈特株式会社 2018-01-23 CN disclosed